| SpectraBase Compound ID | IE9Ha5EudQn |
|---|---|
| InChI | InChI=1S/C9H18O3/c1-3-5-6-9(10)12-8-7-11-4-2/h3-8H2,1-2H3 |
| InChIKey | LNLKWQDISSHMLL-UHFFFAOYSA-N |
| Mol Weight | 174.24 g/mol |
| Molecular Formula | C9H18O3 |
| Exact Mass | 174.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4zTRbvllf3R |
|---|---|
| Name | Valeric acid, 2-ethoxyethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.125594437 u |
| Formula | C9H18O3 |
| InChI | InChI=1S/C9H18O3/c1-3-5-6-9(10)12-8-7-11-4-2/h3-8H2,1-2H3 |
| InChIKey | LNLKWQDISSHMLL-UHFFFAOYSA-N |
| Molecular Weight | 174.240 g/mol |
| SMILES | C(CCC)C(=O)OCCOCC |